Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | F2R | P25116 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19120888 | 0.78 | CHRNA7 (0.43) | CHRNA7F2R | |
| SCHEMBL23006094 | 0.77 | HTR1A (0.44) | CHRNA7HTR1ADRD2DRD4KCNH2 | |
| SCHEMBL2609309 | 0.75 | CHRNA7 (0.46) | CHRNA7HTR1ADRD2DRD4KCNH2 | |
| SCHEMBL6984191 | 0.70 | CHRNA7 (0.43) | CHRNA7HTR1ADRD2DRD4KCNH2 | |
| SCHEMBL17896353 | 0.70 | HTR1A (0.40) | CHRNA7HTR1ADRD2DRD4KCNH2 | |
| SCHEMBL23103361 | 0.68 | TLR9 (0.42) | CHRNA7 | |
| SCHEMBL23103107 | 0.67 | CHRNA7 (0.43) | CHRNA7HTR1ADRD2DRD4KCNH2 | |
| SCHEMBL23106870 | 0.66 | CHRNA7 (0.42) | CHRNA7HTR1ADRD2DRD4KCNH2 | |
| SCHEMBL30472085 | 0.66 | CHRNA7 (0.39) | CHRNA7 | |
| SCHEMBL27266356 | 0.64 | HTR1A (0.41) | CHRNA7HTR1ADRD2DRD4KCNH2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3185865-B1 | TETRAHYDRONAPTHTYRIDINE DERIVATIVES AS MGLUR2 NEGATIVE ALLOSTERIC MODULATORS, COMPOSITIONS, AND THEIR USE. | MERCK SHARP & DOHME (US) | 2020-07-15 | — | — | EP | disclosed |